Dy12Ho5Er2
Alexandria ALEXAlex-ID: agm005666980 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_341_spg2
Dy3(Ho2Er)2 HoEr5 Dy5Ho
2023-06-23 06:48:05.198307
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005666980).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm005666980
data_agm005666980
_cell_length_a 6.44656
_cell_length_b 8.79694
_cell_length_c 11.80247
_cell_angle_alpha 115.04984
_cell_angle_beta 98.72855
_cell_angle_gamma 81.97891
_cell_volume 597.21751
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Dy1 Dy 0.94473 0.11152 0.26842 1.00000
Dy2 Dy 0.03066 0.63055 0.86991 1.00000
Dy3 Dy 0.66598 0.70324 0.07571 1.00000
Dy4 Dy 0.22350 0.55625 0.45910 1.00000
Dy5 Dy 0.70458 0.68865 0.35836 1.00000
Dy6 Dy 0.52603 0.93664 0.63667 1.00000
Dy7 Dy 0.47397 0.06336 0.36333 1.00000
Dy8 Dy 0.77650 0.44375 0.54090 1.00000
Dy9 Dy 0.29542 0.31135 0.64164 1.00000
Dy10 Dy 0.96934 0.36945 0.13009 1.00000
Dy11 Dy 0.33402 0.29676 0.92429 1.00000
Dy12 Dy 0.05527 0.88848 0.73158 1.00000
Ho1 Ho 0.48760 0.67258 0.78233 1.00000
Ho2 Ho 0.19491 0.71004 0.19904 1.00000
Ho3 Ho 0.00000 0.00000 0.50000 1.00000
Ho4 Ho 0.80509 0.28996 0.80096 1.00000
Ho5 Ho 0.51240 0.32742 0.21767 1.00000
Er1 Er 0.73568 0.01628 0.96012 1.00000
Er2 Er 0.26432 0.98372 0.03988 1.00000
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